Y7Q
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C01 | sing | 1.51Å | 1.51Å | |
| C03 | C02 | doub | 1.38Å | 1.38Å | Aromatic |
| C04 | C03 | sing | 1.38Å | 1.43Å | Aromatic |
| C05 | C04 | sing | 1.51Å | 1.48Å | |
| C06 | C04 | doub | 1.38Å | 1.40Å | Aromatic |
| O08 | S07 | doub | 1.42Å | 1.45Å | |
| O09 | S07 | doub | 1.42Å | 1.44Å | |
| N10 | S07 | sing | 1.66Å | 1.67Å | |
| C11 | N10 | sing | 1.40Å | 1.52Å | |
| C12 | C11 | doub | 1.39Å | 1.44Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C13 | doub | 1.39Å | 1.43Å | Aromatic |
| C15 | C14 | sing | 1.41Å | 1.39Å | Aromatic |
| C16 | C15 | doub | 1.40Å | 1.44Å | Aromatic |
| N17 | C15 | sing | 1.36Å | 1.45Å | Aromatic |
| C18 | N17 | doub | 1.30Å | 1.42Å | Aromatic |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| C21 | C20 | sing | 1.53Å | 1.56Å | |
| C22 | C21 | sing | 1.53Å | 1.57Å | |
| C23 | C22 | sing | 1.53Å | 1.54Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| N26 | C25 | sing | 1.47Å | 1.46Å | |
| C19 | C18 | sing | 1.51Å | 1.52Å | |
| N27 | C18 | sing | 1.36Å | 1.41Å | Aromatic |
| C28 | N27 | sing | 1.47Å | 1.46Å | |
| C29 | C28 | sing | 1.51Å | 1.52Å | |
| C30 | C29 | doub | 1.38Å | 1.40Å | Aromatic |
| C31 | C30 | sing | 1.38Å | 1.43Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.42Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
| C34 | C33 | doub | 1.38Å | 1.40Å | Aromatic |
| S07 | C06 | sing | 1.76Å | 1.81Å | |
| C35 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| C36 | C35 | sing | 1.51Å | 1.55Å | |
| C37 | C35 | doub | 1.38Å | 1.43Å | Aromatic |
| C02 | C37 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C16 | sing | 1.38Å | 1.42Å | Aromatic |
| C14 | N27 | sing | 1.38Å | 1.45Å | Aromatic |
| C29 | C34 | sing | 1.38Å | 1.42Å | Aromatic |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C05 | H053 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å | |
| C36 | H363 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| N10 | H101 | sing | 0.97Å | 1.00Å | |
| N26 | H262 | sing | 1.01Å | 1.00Å | |
| N26 | H1 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 119.2° | 120.0° |
| C01 | C02 | C37 | 120.5° | 120.0° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C03 | C04 | 121.1° | 120.0° |
| C03 | C02 | C37 | 120.3° | 120.0° |
| C02 | C03 | H031 | 119.4° | 120.0° |
| C03 | C04 | C05 | 116.9° | 120.0° |
| C03 | C04 | C06 | 118.9° | 120.0° |
| C04 | C03 | H031 | 119.4° | 120.0° |
| C05 | C04 | C06 | 124.2° | 120.0° |
| C04 | C05 | H053 | 109.5° | 109.4° |
| C04 | C05 | H051 | 109.5° | 109.4° |
| C04 | C05 | H052 | 109.5° | 109.5° |
| C04 | C06 | S07 | 123.5° | 120.0° |
| C04 | C06 | C35 | 119.4° | 120.0° |
| O08 | S07 | O09 | 99.0° | 123.2° |
| O08 | S07 | N10 | 109.7° | 106.4° |
| O08 | S07 | C06 | 108.8° | 106.4° |
| O09 | S07 | N10 | 110.1° | 106.4° |
| O09 | S07 | C06 | 115.5° | 106.4° |
| S07 | N10 | C11 | 130.7° | 120.0° |
| N10 | S07 | C06 | 112.6° | 107.2° |
| S07 | N10 | H101 | 103.9° | 120.0° |
| N10 | C11 | C12 | 118.2° | 119.8° |
| N10 | C11 | C16 | 123.5° | 119.8° |
| C11 | N10 | H101 | 103.9° | 120.1° |
| C11 | C12 | C13 | 122.1° | 120.4° |
| C12 | C11 | C16 | 118.3° | 120.3° |
| C11 | C12 | H121 | 118.9° | 119.8° |
| C12 | C13 | C14 | 119.3° | 119.9° |
| C12 | C13 | H131 | 120.3° | 120.1° |
| C13 | C12 | H121 | 118.9° | 119.8° |
| C13 | C14 | C15 | 119.3° | 120.0° |
| C13 | C14 | N27 | 133.6° | 134.0° |
| C14 | C13 | H131 | 120.3° | 120.0° |
| C14 | C15 | C16 | 122.0° | 119.6° |
| C14 | C15 | N17 | 107.1° | 107.0° |
| C15 | C14 | N27 | 107.1° | 106.0° |
| C16 | C15 | N17 | 131.0° | 133.5° |
| C15 | C16 | C11 | 118.9° | 119.7° |
| C15 | C16 | H161 | 120.5° | 120.2° |
| C15 | N17 | C18 | 103.0° | 109.6° |
| N17 | C18 | C19 | 113.3° | 124.9° |
| N17 | C18 | N27 | 104.8° | 110.1° |
| C19 | C20 | C21 | 112.8° | 109.5° |
| C20 | C19 | C18 | 105.0° | 109.5° |
| C19 | C20 | H202 | 108.6° | 109.4° |
| C19 | C20 | H201 | 108.7° | 109.4° |
| C20 | C19 | H192 | 110.6° | 109.5° |
| C20 | C19 | H191 | 110.6° | 109.4° |
| C20 | C21 | C22 | 108.6° | 109.5° |
| C21 | C20 | H202 | 108.6° | 109.5° |
| C21 | C20 | H201 | 108.6° | 109.5° |
| C20 | C21 | H212 | 109.7° | 109.5° |
| C20 | C21 | H211 | 109.7° | 109.4° |
| C21 | C22 | C23 | 110.7° | 109.5° |
| C22 | C21 | H212 | 109.7° | 109.6° |
| C22 | C21 | H211 | 109.7° | 109.4° |
| C21 | C22 | H221 | 109.2° | 109.5° |
| C21 | C22 | H222 | 109.2° | 109.4° |
| C22 | C23 | C24 | 111.2° | 109.5° |
| C23 | C22 | H221 | 109.2° | 109.5° |
| C23 | C22 | H222 | 109.2° | 109.4° |
| C22 | C23 | H232 | 109.0° | 109.5° |
| C22 | C23 | H231 | 109.0° | 109.5° |
| C23 | C24 | C25 | 113.3° | 109.5° |
| C23 | C24 | H242 | 108.5° | 109.4° |
| C23 | C24 | H241 | 108.5° | 109.5° |
| C24 | C23 | H232 | 109.0° | 109.4° |
| C24 | C23 | H231 | 109.0° | 109.4° |
| C24 | C25 | N26 | 110.6° | 109.5° |
| C25 | C24 | H242 | 108.5° | 109.5° |
| C25 | C24 | H241 | 108.5° | 109.5° |
| C24 | C25 | H252 | 109.1° | 109.5° |
| C24 | C25 | H251 | 109.2° | 109.5° |
| N26 | C25 | H252 | 109.2° | 109.4° |
| N26 | C25 | H251 | 109.2° | 109.5° |
| C25 | N26 | H262 | 109.5° | 111.0° |
| C25 | N26 | H1 | 109.4° | 111.0° |
| C19 | C18 | N27 | 110.1° | 124.9° |
| C18 | C19 | H192 | 110.6° | 109.5° |
| C18 | C19 | H191 | 110.6° | 109.5° |
| C18 | N27 | C28 | 125.5° | 126.4° |
| C18 | N27 | C14 | 102.9° | 107.3° |
| N27 | C28 | C29 | 108.6° | 109.5° |
| C28 | N27 | C14 | 130.9° | 126.4° |
| N27 | C28 | H281 | 109.7° | 109.4° |
| N27 | C28 | H282 | 109.7° | 109.5° |
| C28 | C29 | C30 | 120.2° | 120.0° |
| C28 | C29 | C34 | 119.9° | 119.9° |
| C29 | C28 | H281 | 109.7° | 109.5° |
| C29 | C28 | H282 | 109.7° | 109.5° |
| C29 | C30 | C31 | 120.0° | 120.0° |
| C30 | C29 | C34 | 120.0° | 120.0° |
| C29 | C30 | H301 | 120.0° | 120.0° |
| C30 | C31 | C32 | 119.5° | 120.0° |
| C31 | C30 | H301 | 120.0° | 120.1° |
| C30 | C31 | H311 | 120.2° | 120.0° |
| C31 | C32 | C33 | 120.0° | 120.0° |
| C32 | C31 | H311 | 120.3° | 120.0° |
| C31 | C32 | H321 | 120.0° | 120.0° |
| C32 | C33 | C34 | 120.4° | 120.0° |
| C33 | C32 | H321 | 120.0° | 119.9° |
| C32 | C33 | H331 | 119.8° | 120.0° |
| C33 | C34 | C29 | 120.1° | 119.9° |
| C34 | C33 | H331 | 119.8° | 120.0° |
| C33 | C34 | H341 | 119.9° | 120.0° |
| S07 | C06 | C35 | 117.1° | 120.0° |
| C06 | C35 | C36 | 120.8° | 120.0° |
| C06 | C35 | C37 | 120.9° | 120.0° |
| C36 | C35 | C37 | 118.3° | 120.0° |
| C35 | C36 | H361 | 109.5° | 109.5° |
| C35 | C36 | H362 | 109.5° | 109.4° |
| C35 | C36 | H363 | 109.4° | 109.4° |
| C35 | C37 | C02 | 119.3° | 120.0° |
| C35 | C37 | H371 | 120.3° | 120.0° |
| C02 | C37 | H371 | 120.4° | 120.0° |
| C11 | C16 | H161 | 120.5° | 120.1° |
| C29 | C34 | H341 | 120.0° | 120.0° |
| H202 | C20 | H201 | 109.5° | 109.5° |
| H212 | C21 | H211 | 109.5° | 109.4° |
| H221 | C22 | H222 | 109.5° | 109.5° |
| H242 | C24 | H241 | 109.5° | 109.5° |
| H281 | C28 | H282 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.5° | 109.4° |
| H012 | C01 | H011 | 109.4° | 109.4° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H053 | C05 | H051 | 109.4° | 109.5° |
| H053 | C05 | H052 | 109.4° | 109.5° |
| H051 | C05 | H052 | 109.5° | 109.5° |
| H192 | C19 | H191 | 109.5° | 109.4° |
| H232 | C23 | H231 | 109.5° | 109.5° |
| H252 | C25 | H251 | 109.5° | 109.5° |
| H361 | C36 | H362 | 109.5° | 109.5° |
| H361 | C36 | H363 | 109.5° | 109.5° |
| H362 | C36 | H363 | 109.5° | 109.5° |
| H262 | N26 | H1 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | C37 | 179.7° | 179.7° |
| C01 | C02 | C03 | C04 | 179.7° | 180.0° |
| C01 | C02 | C37 | C35 | 179.7° | 179.7° |
| C02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C02 | C01 | H012 | H011 | 120.0° | 120.0° |
| C02 | C01 | H013 | H011 | 120.0° | 120.0° |
| C01 | C02 | C03 | H031 | 0.3° | 0.0° |
| C01 | C02 | C37 | H371 | 0.3° | 0.0° |
| C02 | C03 | C04 | H031 | 180.0° | 180.0° |
| C02 | C03 | C04 | C05 | 179.9° | 180.0° |
| C02 | C03 | C04 | C06 | 0.4° | 0.0° |
| C03 | C02 | C37 | C35 | 0.0° | 0.5° |
| C03 | C02 | C01 | H012 | 90.1° | 89.7° |
| C03 | C02 | C01 | H013 | 149.9° | 30.3° |
| C03 | C02 | C01 | H011 | 29.8° | 150.3° |
| C03 | C02 | C37 | H371 | 180.0° | 179.7° |
| C03 | C04 | C05 | C06 | 179.6° | 180.0° |
| C03 | C04 | C06 | S07 | 179.4° | 180.0° |
| C03 | C04 | C06 | C35 | 0.8° | 0.0° |
| C04 | C03 | C02 | C37 | 0.0° | 0.3° |
| C03 | C04 | C05 | H053 | 90.2° | 98.9° |
| C03 | C04 | C05 | H051 | 149.9° | 141.1° |
| C03 | C04 | C05 | H052 | 29.8° | 21.1° |
| C05 | C04 | C06 | S07 | 0.3° | 0.0° |
| C05 | C04 | C06 | C35 | 179.6° | 179.9° |
| C05 | C04 | C03 | H031 | 0.0° | 0.0° |
| C04 | C05 | H053 | H051 | 120.0° | 119.9° |
| C04 | C05 | H053 | H052 | 120.0° | 120.0° |
| C04 | C05 | H051 | H052 | 120.0° | 120.0° |
| C04 | C06 | S07 | O08 | 114.1° | 15.8° |
| C04 | C06 | S07 | O09 | 3.8° | 148.7° |
| C04 | C06 | S07 | N10 | 124.0° | 97.7° |
| C04 | C06 | S07 | C35 | 179.9° | 179.9° |
| C04 | C06 | C35 | C36 | 179.3° | 180.0° |
| C04 | C06 | C35 | C37 | 0.8° | 0.3° |
| C06 | C04 | C03 | H031 | 179.6° | 180.0° |
| C06 | C04 | C05 | H053 | 90.2° | 81.1° |
| C06 | C04 | C05 | H051 | 29.8° | 38.9° |
| C06 | C04 | C05 | H052 | 149.8° | 158.9° |
| O08 | S07 | O09 | N10 | 115.0° | 123.0° |
| O08 | S07 | O09 | C06 | 116.0° | 122.9° |
| O08 | S07 | N10 | C06 | 121.4° | 113.5° |
| O08 | S07 | N10 | C11 | 167.4° | 46.9° |
| O08 | S07 | C06 | C35 | 65.8° | 164.2° |
| O08 | S07 | N10 | H101 | 69.9° | 133.0° |
| O09 | S07 | N10 | C06 | 130.6° | 113.5° |
| O09 | S07 | N10 | C11 | 84.6° | 179.8° |
| O09 | S07 | C06 | C35 | 176.0° | 31.3° |
| O09 | S07 | N10 | H101 | 38.1° | 0.1° |
| S07 | N10 | C11 | H101 | 122.7° | 179.9° |
| S07 | N10 | C11 | C12 | 169.8° | 49.3° |
| N10 | S07 | C06 | C35 | 56.2° | 82.2° |
| S07 | N10 | C11 | C16 | 10.5° | 131.3° |
| N10 | C11 | C12 | C16 | 179.7° | 179.4° |
| N10 | C11 | C12 | C13 | 179.5° | 179.9° |
| N10 | C11 | C16 | C15 | 179.8° | 180.0° |
| C11 | N10 | S07 | C06 | 46.0° | 66.6° |
| N10 | C11 | C12 | H121 | 0.5° | 0.0° |
| N10 | C11 | C16 | H161 | 0.2° | 0.0° |
| C11 | C12 | C13 | H121 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.7° | 0.2° |
| C12 | C11 | C16 | C15 | 0.2° | 0.6° |
| C11 | C12 | C13 | H131 | 179.3° | 180.0° |
| C12 | C11 | C16 | H161 | 179.8° | 179.4° |
| C12 | C11 | N10 | H101 | 47.1° | 130.8° |
| C12 | C13 | C14 | H131 | 180.0° | 179.8° |
| C12 | C13 | C14 | C15 | 0.9° | 0.0° |
| C13 | C12 | C11 | C16 | 0.1° | 0.5° |
| C12 | C13 | C14 | N27 | 179.9° | 179.9° |
| C13 | C14 | C15 | N27 | 179.4° | 180.0° |
| C13 | C14 | C15 | C16 | 0.6° | 0.0° |
| C13 | C14 | C15 | N17 | 179.3° | 180.0° |
| C13 | C14 | N27 | C18 | 156.3° | 180.0° |
| C13 | C14 | N27 | C28 | 14.6° | 0.0° |
| C14 | C13 | C12 | H121 | 179.3° | 179.7° |
| C14 | C15 | C16 | N17 | 179.8° | 180.0° |
| C14 | C15 | N17 | C18 | 22.8° | 0.0° |
| C15 | C14 | N27 | C18 | 23.0° | 0.0° |
| C15 | C14 | N27 | C28 | 166.1° | 180.0° |
| C14 | C15 | C16 | C11 | 0.0° | 0.3° |
| C15 | C14 | C13 | H131 | 179.1° | 179.7° |
| C14 | C15 | C16 | H161 | 180.0° | 179.7° |
| C16 | C15 | N17 | C18 | 157.1° | 180.0° |
| C15 | C16 | C11 | H161 | 180.0° | 180.0° |
| C16 | C15 | C14 | N27 | 180.0° | 180.0° |
| C15 | N17 | C18 | C19 | 157.5° | 180.0° |
| C15 | N17 | C18 | N27 | 37.5° | 0.0° |
| N17 | C15 | C16 | C11 | 179.8° | 179.7° |
| N17 | C15 | C14 | N27 | 0.1° | 0.0° |
| N17 | C15 | C16 | H161 | 0.2° | 0.4° |
| N17 | C18 | C19 | C20 | 125.1° | 90.0° |
| N17 | C18 | C19 | N27 | 116.9° | 180.0° |
| N17 | C18 | N27 | C28 | 150.9° | 180.0° |
| N17 | C18 | N27 | C14 | 37.5° | 0.0° |
| N17 | C18 | C19 | H192 | 115.6° | 30.0° |
| N17 | C18 | C19 | H191 | 5.8° | 150.0° |
| C19 | C20 | C21 | H202 | 120.5° | 120.0° |
| C19 | C20 | C21 | H201 | 120.5° | 120.0° |
| C19 | C20 | C21 | C22 | 121.8° | 179.9° |
| C20 | C19 | C18 | H192 | 119.3° | 120.1° |
| C20 | C19 | C18 | H191 | 119.3° | 120.0° |
| C20 | C19 | C18 | N27 | 118.0° | 90.0° |
| C19 | C20 | H202 | H201 | 118.5° | 119.9° |
| C19 | C20 | C21 | H212 | 1.9° | 59.9° |
| C19 | C20 | C21 | H211 | 118.4° | 60.0° |
| C20 | C19 | H192 | H191 | 122.1° | 119.9° |
| C20 | C21 | C22 | H212 | 119.8° | 120.1° |
| C20 | C21 | C22 | H211 | 119.9° | 119.9° |
| C20 | C21 | C22 | C23 | 93.1° | NaN° |
| C21 | C20 | C19 | C18 | 148.5° | 180.0° |
| C21 | C20 | H202 | H201 | 118.4° | 120.1° |
| C20 | C21 | H212 | H211 | 120.4° | 119.9° |
| C20 | C21 | C22 | H221 | 27.1° | 60.0° |
| C20 | C21 | C22 | H222 | 146.7° | 60.1° |
| C21 | C20 | C19 | H192 | 29.2° | 60.0° |
| C21 | C20 | C19 | H191 | 92.2° | 60.0° |
| C21 | C22 | C23 | H221 | 120.2° | 120.1° |
| C21 | C22 | C23 | H222 | 120.2° | 119.9° |
| C21 | C22 | C23 | C24 | 145.2° | 179.9° |
| C22 | C21 | C20 | H202 | 117.7° | 60.1° |
| C22 | C21 | C20 | H201 | 1.3° | 59.9° |
| C22 | C21 | H212 | H211 | 120.4° | 120.0° |
| C21 | C22 | H221 | H222 | 119.4° | 120.0° |
| C21 | C22 | C23 | H232 | 24.9° | 59.9° |
| C21 | C22 | C23 | H231 | 94.6° | 60.1° |
| C22 | C23 | C24 | H232 | 120.3° | 120.0° |
| C22 | C23 | C24 | H231 | 120.2° | 120.0° |
| C22 | C23 | C24 | C25 | 116.2° | 179.9° |
| C23 | C22 | C21 | H212 | 147.0° | 59.9° |
| C23 | C22 | C21 | H211 | 26.7° | 60.1° |
| C23 | C22 | H221 | H222 | 119.5° | 120.0° |
| C22 | C23 | C24 | H242 | 4.3° | 60.0° |
| C22 | C23 | C24 | H241 | 123.2° | 60.0° |
| C22 | C23 | H232 | H231 | 119.2° | 120.0° |
| C23 | C24 | C25 | H242 | 120.6° | 120.0° |
| C23 | C24 | C25 | H241 | 120.5° | 120.0° |
| C23 | C24 | C25 | N26 | 127.4° | 180.0° |
| C24 | C23 | C22 | H221 | 94.7° | 60.0° |
| C24 | C23 | C22 | H222 | 25.0° | 60.0° |
| C23 | C24 | H242 | H241 | 118.2° | 120.0° |
| C24 | C23 | H232 | H231 | 119.2° | 119.9° |
| C23 | C24 | C25 | H252 | 112.4° | 60.0° |
| C23 | C24 | C25 | H251 | 7.2° | 60.0° |
| C24 | C25 | N26 | H252 | 120.2° | 120.0° |
| C24 | C25 | N26 | H251 | 120.2° | 120.0° |
| C25 | C24 | H242 | H241 | 118.2° | 120.0° |
| C25 | C24 | C23 | H232 | 123.5° | 60.0° |
| C25 | C24 | C23 | H231 | 4.0° | 59.9° |
| C24 | C25 | H252 | H251 | 119.4° | 120.0° |
| C24 | C25 | N26 | H262 | 180.0° | 56.0° |
| C24 | C25 | N26 | H1 | 60.0° | 179.9° |
| N26 | C25 | C24 | H242 | 6.8° | 60.0° |
| N26 | C25 | C24 | H241 | 112.1° | 60.0° |
| N26 | C25 | H252 | H251 | 119.5° | 120.0° |
| C25 | N26 | H262 | H1 | 120.0° | 123.9° |
| C19 | C18 | N27 | C28 | 28.8° | 0.0° |
| C19 | C18 | N27 | C14 | 159.7° | 180.0° |
| C18 | C19 | C20 | H202 | 28.0° | 60.0° |
| C18 | C19 | C20 | H201 | 91.1° | 60.0° |
| C18 | C19 | H192 | H191 | 122.1° | 120.0° |
| C18 | N27 | C28 | C14 | 169.1° | 180.0° |
| C18 | N27 | C28 | C29 | 108.6° | 90.0° |
| C18 | N27 | C28 | H281 | 11.3° | 150.0° |
| C18 | N27 | C28 | H282 | 131.5° | 30.0° |
| N27 | C18 | C19 | H192 | 1.3° | 149.9° |
| N27 | C18 | C19 | H191 | 122.7° | 30.0° |
| N27 | C28 | C29 | H281 | 119.9° | 119.9° |
| N27 | C28 | C29 | H282 | 119.9° | 120.0° |
| N27 | C28 | C29 | C30 | 50.6° | 89.7° |
| N27 | C28 | C29 | C34 | 127.7° | 90.0° |
| N27 | C28 | H281 | H282 | 120.4° | 120.0° |
| C28 | C29 | C30 | C34 | 178.3° | 179.8° |
| C28 | C29 | C30 | C31 | 178.6° | 180.0° |
| C28 | C29 | C34 | C33 | 178.3° | 179.7° |
| C29 | C28 | N27 | C14 | 60.4° | 90.0° |
| C29 | C28 | H281 | H282 | 120.4° | 120.1° |
| C28 | C29 | C30 | H301 | 1.4° | 0.0° |
| C28 | C29 | C34 | H341 | 1.8° | 0.0° |
| C29 | C30 | C31 | H301 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 0.4° | 0.0° |
| C30 | C29 | C34 | C33 | 0.1° | 0.5° |
| C30 | C29 | C28 | H281 | 69.2° | 30.2° |
| C30 | C29 | C28 | H282 | 170.5° | 150.2° |
| C29 | C30 | C31 | H311 | 179.6° | 180.0° |
| C30 | C29 | C34 | H341 | 179.9° | 179.8° |
| C30 | C31 | C32 | H311 | 180.0° | 179.9° |
| C30 | C31 | C32 | C33 | 0.1° | 0.0° |
| C31 | C30 | C29 | C34 | 0.3° | 0.2° |
| C30 | C31 | C32 | H321 | 179.9° | 180.0° |
| C31 | C32 | C33 | H321 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.3° | 0.3° |
| C32 | C31 | C30 | H301 | 179.6° | 180.0° |
| C31 | C32 | C33 | H331 | 179.8° | 179.9° |
| C32 | C33 | C34 | H331 | 180.0° | 179.8° |
| C32 | C33 | C34 | C29 | 0.4° | 0.6° |
| C33 | C32 | C31 | H311 | 179.9° | 180.0° |
| C32 | C33 | C34 | H341 | 179.6° | 179.7° |
| C33 | C34 | C29 | H341 | 180.0° | 179.7° |
| C34 | C33 | C32 | H321 | 179.7° | 179.7° |
| S07 | C06 | C35 | C36 | 0.6° | 0.1° |
| S07 | C06 | C35 | C37 | 179.4° | 179.8° |
| C06 | S07 | N10 | H101 | 168.7° | 113.5° |
| C06 | C35 | C36 | C37 | 179.9° | 179.7° |
| C06 | C35 | C37 | C02 | 0.4° | 0.6° |
| C06 | C35 | C36 | H361 | 90.0° | 83.7° |
| C06 | C35 | C36 | H362 | 150.0° | 156.3° |
| C06 | C35 | C36 | H363 | 30.0° | 36.3° |
| C06 | C35 | C37 | H371 | 179.6° | 179.7° |
| C36 | C35 | C37 | C02 | 179.7° | 179.7° |
| C35 | C36 | H361 | H362 | 120.0° | 120.0° |
| C35 | C36 | H361 | H363 | 120.0° | 120.0° |
| C35 | C36 | H362 | H363 | 120.0° | 120.0° |
| C36 | C35 | C37 | H371 | 0.3° | 0.0° |
| C35 | C37 | C02 | H371 | 180.0° | 179.8° |
| C37 | C35 | C36 | H361 | 90.1° | 96.0° |
| C37 | C35 | C36 | H362 | 29.9° | 24.0° |
| C37 | C35 | C36 | H363 | 150.0° | 144.0° |
| C37 | C02 | C01 | H012 | 90.2° | 90.0° |
| C37 | C02 | C01 | H013 | 29.8° | 150.0° |
| C37 | C02 | C01 | H011 | 149.9° | 30.0° |
| C37 | C02 | C03 | H031 | 180.0° | 179.7° |
| C16 | C11 | C12 | H121 | 179.8° | 179.4° |
| C16 | C11 | N10 | H101 | 133.3° | 48.6° |
| N27 | C14 | C13 | H131 | 0.1° | 0.3° |
| C14 | N27 | C28 | H281 | 179.7° | 30.0° |
| C14 | N27 | C28 | H282 | 59.4° | 149.9° |
| C34 | C29 | C28 | H281 | 112.4° | 150.0° |
| C34 | C29 | C28 | H282 | 7.9° | 30.0° |
| C34 | C29 | C30 | H301 | 179.7° | 179.7° |
| C29 | C34 | C33 | H331 | 179.7° | 179.7° |
| H131 | C13 | C12 | H121 | 0.7° | 0.1° |
| H202 | C20 | C21 | H212 | 122.4° | 60.1° |
| H202 | C20 | C21 | H211 | 2.1° | 180.0° |
| H202 | C20 | C19 | H192 | 91.3° | 180.0° |
| H202 | C20 | C19 | H191 | 147.3° | 60.1° |
| H201 | C20 | C21 | H212 | 118.6° | 179.9° |
| H201 | C20 | C21 | H211 | 121.1° | 60.0° |
| H201 | C20 | C19 | H192 | 149.7° | 60.1° |
| H201 | C20 | C19 | H191 | 28.3° | 180.0° |
| H212 | C21 | C22 | H221 | 92.8° | 180.0° |
| H212 | C21 | C22 | H222 | 26.9° | 60.0° |
| H211 | C21 | C22 | H221 | 146.9° | 60.0° |
| H211 | C21 | C22 | H222 | 93.4° | 180.0° |
| H221 | C22 | C23 | H232 | 145.1° | 180.0° |
| H221 | C22 | C23 | H231 | 25.6° | 60.0° |
| H222 | C22 | C23 | H232 | 95.3° | 60.0° |
| H222 | C22 | C23 | H231 | 145.2° | 180.0° |
| H242 | C24 | C23 | H232 | 115.9° | 180.0° |
| H242 | C24 | C23 | H231 | 124.6° | 60.1° |
| H242 | C24 | C25 | H252 | 127.0° | 180.0° |
| H242 | C24 | C25 | H251 | 113.4° | 60.0° |
| H241 | C24 | C23 | H232 | 3.0° | 60.0° |
| H241 | C24 | C23 | H231 | 116.5° | 180.0° |
| H241 | C24 | C25 | H252 | 8.1° | 60.0° |
| H241 | C24 | C25 | H251 | 127.8° | 180.0° |
| H012 | C01 | H013 | H011 | 120.0° | 120.0° |
| H053 | C05 | H051 | H052 | 119.9° | 120.1° |
| H252 | C25 | N26 | H262 | 59.8° | 64.0° |
| H252 | C25 | N26 | H1 | 179.8° | 60.0° |
| H251 | C25 | N26 | H262 | 59.8° | 176.0° |
| H251 | C25 | N26 | H1 | 60.1° | 60.0° |
| H301 | C30 | C31 | H311 | 0.4° | 0.1° |
| H311 | C31 | C32 | H321 | 0.1° | 0.0° |
| H321 | C32 | C33 | H331 | 0.3° | 0.0° |
| H331 | C33 | C34 | H341 | 0.4° | 0.0° |
| H361 | C36 | H362 | H363 | 120.0° | 120.0° |
